2,4-Difluoro-1,1'-biphenyl

• CAS: 37847-52-2
• Catalog Number: ACM37847522
• Category: Aryl Fluorinated Building Blocks
• Molecular Weight: 190.19g/mol
• Molecular Formula: C12H8F2
• IUPAC Name: 2,4-difluoro-1-phenylbenzene
• Canonical SMILES: C1=CC=C(C=C1)C2=C(C=C(C=C2)F)F
• InChI: InChI=1S/C12H8F2/c13-10-6-7-11(12(14)8-10)9-4-2-1-3-5-9/h1-8H
• InChI Key: JVHAJKHGPDDEEU-UHFFFAOYSA-N
• Complexity: 175
• Covalently-Bonded Unit Count: 1
• EC Number: 253-690-2
• Exact Mass: 190.059407g/mol
• Formal Charge: 0
• Hazard Statements: H302-H412
• H-Bond Acceptor: 2
• H-Bond Donor: 0
• Heavy Atom Count: 14
• Monoisotopic Mass: 190.059407g/mol
• RIDADR: UN 3261 8 / PGII
• Rotatable Bond Count: 1
• Symbol: GHS07
• XLogP3: 4.2

Custom Q&A

What is the molecular formula of 2,4-Difluoro-1,1'-biphenyl?

The molecular formula is C12H8F2.

When was the compound 2,4-Difluoro-1,1'-biphenyl created and last modified?

It was created on 2005-07-19 and last modified on 2023-12-23.

What are some synonyms for 2,4-Difluoro-1,1'-biphenyl?

Some synonyms include 2,4-Difluorobiphenyl, 2,4-Difluoro-1,1'-biphenyl, and 2,4-difluoro-1-phenylbenzene.

What is the molecular weight of 2,4-Difluoro-1,1'-biphenyl?

The molecular weight is 190.19 g/mol.

What is the Canonical SMILES representation of 2,4-Difluoro-1,1'-biphenyl?

The Canonical SMILES is C1=CC=C(C=C1)C2=C(C=C(C=C2)F)F.

What is the InChIKey for 2,4-Difluoro-1,1'-biphenyl?

The InChIKey is JVHAJKHGPDDEEU-UHFFFAOYSA-N.

How many hydrogen bond acceptors does 2,4-Difluoro-1,1'-biphenyl have?

It has 2 hydrogen bond acceptors.

What is the topological polar surface area of 2,4-Difluoro-1,1'-biphenyl?

The topological polar surface area is 0-2.

How many heavy atoms are present in the compound?

There are 14 heavy atoms present in the compound.

Is the compound 2,4-Difluoro-1,1'-biphenyl canonicalized?

Yes, the compound is canonicalized.